4-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}benzoic acid
Chemical Structure Depiction of
4-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}benzoic acid
4-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}benzoic acid
Compound characteristics
| Compound ID: | 8009-3926 |
| Compound Name: | 4-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}benzoic acid |
| Molecular Weight: | 312.35 |
| Molecular Formula: | C15 H12 N4 O2 S |
| Smiles: | C(c1ccc(cc1)C(O)=O)Sc1nnnn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9464 |
| logD: | -0.0251 |
| logSw: | -3.2199 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.297 |
| InChI Key: | ZBZGROSUAMJLFK-UHFFFAOYSA-N |